2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide
TL;DR: 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide (CAS 21602-31-3) is a chemical compound with molecular formula C14H14N2O3S2 and molecular weight 322.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-4-ethyl-1,1-dioxothieno[2,3-e][1,2,4]thiadiazin-3-one
Also Known As: 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide, 2-benzyl-4-ethyl-2h-thieno[2,3-e][1,2,4]thiadiazin-3(4h)-one 1,1-dioxide, 4-Ethyl-2-benzylthiopheno(2,3-e)1,2,4-thiadiazine-1,1,3-trione, 1,1,3-Trioxo-2H,4H-thieno[3,4-e][1,2,4]thiadiazine der., 2-benzyl-4-ethyl-1,1-dioxo-thieno[2,3-e][1,2,4]thiadiazin-3-one
| Molecular Formula | C14H14N2O3S2 |
|---|---|
| Molecular Weight | 322.04 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 94.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.0446 |
| Heavy Atoms | 21 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 21602-31-3 |
|---|---|
| SMILES | CCN1C2=C(C=CS2)S(=O)(=O)N(C1=O)CC3=CC=CC=C3 |
| InChIKey | QRTJNKVYYLUNSP-UHFFFAOYSA-N |
Product Overview
2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide (CAS 21602-31-3), with molecular formula C14H14N2O3S2 and molecular weight 322.04 g/mol. IUPAC: 2-benzyl-4-ethyl-1,1-dioxothieno[2,3-e][1,2,4]thiadiazin-3-one.
Chemical Property Profile of 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide
Property Insights of 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide. The TPSA of 94.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide. Following Lipinski's Rule of Five, 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide?
The CAS number of 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide is 21602-31-3.
What is the molecular formula of 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide?
The molecular formula of 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide is C14H14N2O3S2.
What is the molecular weight of 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide?
The molecular weight of 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide is 322.04 g/mol.
Where can I buy 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide?
You can request a quote for 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 2H-Thieno(2,3-e)-1,2,4-thiadiazin-3(4H)-one, 4-ethyl-2-(phenylmethyl)-, 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.